5-(5-phenylmethoxy-1H-indol-3-yl)-3,4,5,10-tetrahydro-2H-azepino[3,4-b]indol-1-one

Systemtic Name: 5-(5-phenylmethoxy-1H-indol-3-yl)-3,4,5,10-tetrahydro-2H-azepino[3,4-b]indol-1-one Openeye Name: 5-(5-benzyloxy-1H-indol-3-yl)-3,4,5,10-tetrahydro-2H-azepino[3,4-b]indol-1-one CAS Name: 5-(5-phenylmethoxy-1H-indol-3-yl)-3,4,5,10-tetrahydro-2H-azepino[3,4-b]indol-1-one IUPAC Name: 5-(5-phenylmethoxy-1H-indol-3-yl)-3,4,5,10-tetrahydro-2H-azepino[3,4-b]indol-1-one Traditional Name: 5-(5-benzoxy-1H-indol-3-yl)-3,4,5,10-tetrahydro-2H-azepin[3,4-b]indol-1-one Formula: C27H23N3O2 MolecularWeight: 421.49042

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(=O)C2=C(C1C3=CNC4=C3C=C(C=C4)OCC5=CC=CC=C5)C6=CC=CC=C6N2

Isomeric SMILES

C1CNC(=O)C2=C(C1C3=CNC4=C3C=C(C=C4)OCC5=CC=CC=C5)C6=CC=CC=C6N2

InChI

InChI=1S/C27H23N3O2/c31-27-26-25(20-8-4-5-9-24(20)30-26)19(12-13-28-27)22-15-29-23-11-10-18(14-21(22)23)32-16-17-6-2-1-3-7-17/h1-11,14-15,19,29-30H,12-13,16H2,(H,28,31)